NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0928 8.0549 120.3906 62.4144 32.5973 175.1557 2 L 3.9626 8.2752 127.4858 52.5107 42.2382 176.0406 3 S 4.5208 9.7093 119.3560 57.7303 66.1903 175.0658 4 E 4.2703 8.8544 121.6540 59.7380 29.2484 179.9357 5 G 3.6237 8.1013 105.1554 47.7528 0.0000 175.4164 6 E 3.9158 8.2063 120.9512 59.0596 29.3941 179.4666 7 W 4.4441 8.2809 119.1325 59.9378 29.1093 178.3703 8 Q 4.0879 8.6101 119.7150 59.1091 28.4476 178.2955 9 L 4.0897 8.0093 120.0430 57.6463 41.6591 179.5879 10 V 3.7552 8.0251 118.1436 66.2213 31.6374 177.9563 11 L 4.3956 8.5053 118.0609 57.0118 41.3549 178.8663 12 H 4.2502 8.2882 118.5625 59.1941 30.2977 177.2818 13 V 3.7476 7.8914 120.7287 64.4963 31.4071 178.1615 14 W 3.8640 8.6059 128.8500 60.0599 30.3013 177.8076 15 A 4.0210 8.0491 120.0872 54.9144 18.1026 179.4540 16 K 3.9073 7.6514 116.8826 59.3965 31.9528 179.7417 17 V 3.0022 6.9230 118.1429 65.4980 31.1627 177.1978 18 E 3.9536 7.3088 115.3756 57.4908 29.3566 178.1551 19 A 4.2023 7.4279 120.6072 53.4443 19.9986 177.6851 20 D 4.6534 7.9681 116.2647 52.1356 43.0105 175.5501 21 V 3.5012 7.8478 123.7075 65.9201 32.0431 176.8013 22 A 4.0519 7.9856 120.0798 55.0409 18.2937 179.7079 23 G 3.7144 8.3789 105.6326 45.4683 0.0000 175.6770 24 H 4.1465 8.1984 118.7109 58.5617 28.6834 178.1846 25 G 3.5365 8.3137 107.6742 47.6642 0.0000 175.7517 26 Q 3.8674 8.1803 120.4555 58.9518 28.7979 178.6652 27 D 4.2893 7.9990 119.6866 57.4163 40.7456 179.1323 28 I 3.6710 7.8952 120.4019 64.3645 37.0714 178.5510 29 L 3.4260 7.7896 119.8587 57.4699 41.2139 179.6576 30 I 3.5703 7.6570 119.9788 64.2301 36.9549 178.3875 31 R 3.7740 7.9199 119.5493 59.1852 29.8979 178.1717 32 L 3.9438 7.8836 120.2212 58.4505 41.5948 179.1367 33 F 4.5874 8.1087 117.8406 60.4291 38.5412 178.0290 34 K 4.0269 8.1855 117.7503 59.6441 32.0226 179.4396 35 S 4.2803 8.1947 114.4947 60.3910 64.0264 174.5793 36 H 4.6810 8.0700 118.3803 52.2281 29.5788 171.9416 37 P 4.5544 0.0000 0.0000 64.2837 31.4792 177.4530 38 E 4.0714 8.2363 116.5442 59.4038 29.3404 179.1624 39 T 4.0281 8.1924 111.6124 64.6084 68.8576 176.4255 40 L 3.5877 7.8753 123.4021 57.7571 41.8008 178.5354 41 E 3.9769 7.6885 117.6958 58.8606 29.6122 178.3506 42 K 4.4662 8.0347 116.7887 56.8837 32.7342 176.8920 43 F 4.6611 8.2607 119.4988 55.3259 38.8287 175.6822 44 D 4.3974 8.6544 126.4963 57.1779 40.8864 178.7180 45 R 3.8192 7.8886 117.9735 58.2656 30.2331 176.6381 46 F 5.0539 8.0669 114.0609 56.6610 40.8489 176.5132 47 K 4.1264 8.1372 119.0108 58.5054 32.5315 177.6108 48 H 4.3589 8.0916 114.8945 57.6406 28.8950 175.4861 49 L 4.1571 7.6955 121.7484 54.4502 41.6903 176.7403 50 K 4.5381 9.4440 122.4637 55.9619 34.3881 176.5565 51 T 4.7472 7.5051 108.5396 58.8416 73.1587 174.1624 52 E 3.9061 8.6622 121.7326 59.4305 29.6960 178.8405 53 A 3.9829 7.9690 120.3557 55.2034 18.2355 179.3121 54 E 3.9353 8.1622 116.2842 59.7357 29.9350 179.1090 55 M 4.1855 8.1446 118.7135 58.4938 31.8509 179.0808 56 K 4.0145 8.2420 117.2859 58.8203 32.2764 178.4545 57 A 4.4734 7.6563 118.9261 51.7161 19.2199 177.0588 58 S 4.3480 7.5249 113.4111 57.1639 62.5378 174.3745 59 E 4.0000 8.8503 129.5995 59.3344 29.4340 177.9718 60 D 4.4194 8.1886 117.8420 57.1564 41.2732 177.8375 61 L 3.4644 8.1252 121.1250 57.6993 42.1539 178.7904 62 K 3.8552 7.9497 119.3557 59.3918 32.1290 178.8701 63 K 3.9969 8.3450 118.9346 59.8894 31.9565 178.8477 64 H 4.4122 8.6880 118.6578 59.1210 29.7622 177.3768 65 G 3.6059 8.4015 108.0161 47.8008 0.0000 175.8242 66 V 3.6031 7.7271 119.9589 66.0159 31.5828 178.0690 67 T 3.8800 7.9206 115.5418 66.7385 68.3066 176.6188 68 V 3.5807 7.9063 119.9093 66.2201 31.5962 178.1877 69 L 4.2420 8.1790 118.6328 57.8582 41.4075 179.6621 70 T 3.9671 8.3829 116.1570 66.5432 68.3909 176.5257 71 A 3.9992 8.0182 122.6916 55.0770 18.3620 179.4769 72 L 3.7535 8.1794 119.1109 58.0771 42.1276 179.3993 73 G 3.2237 8.5220 105.9356 47.5872 0.0000 175.5341 74 A 4.0018 7.7875 122.2397 54.8063 18.6362 179.5732 75 I 3.7834 7.6100 118.2902 64.6269 37.1946 178.6667 76 L 3.9967 7.8945 120.1201 57.6568 41.1910 179.4229 77 K 4.0153 7.7614 116.4397 58.0098 32.2792 178.5995 78 K 3.9750 7.8517 118.5992 55.8944 32.5652 176.5614 79 K 2.0000 8.3183 118.2636 56.3565 29.7862 175.8477 80 G 3.9282 8.0031 106.3551 45.7207 0.0000 173.9282 81 H 4.5745 7.4724 119.1645 55.4516 27.6917 174.9430 82 H 5.2902 7.3077 110.2619 54.3980 29.8591 176.2388 83 E 3.9419 8.6262 122.6598 60.3646 29.0295 178.5581 84 A 4.0671 7.9215 118.7224 55.1018 17.5566 178.9811 85 E 4.1108 8.1143 116.8450 59.4086 29.7207 179.1369 86 L 4.3172 8.1796 118.9011 56.9864 41.6999 179.2017 87 K 3.8461 7.8999 118.7564 59.2930 32.0274 177.4041 88 P 4.2992 0.0000 0.0000 65.5530 31.3054 178.1680 89 L 3.9756 7.5136 120.1828 57.9694 42.0407 178.7836 90 A 4.1300 8.5363 121.0811 55.2324 18.2752 179.5513 91 Q 3.7808 8.1466 116.7416 59.1165 28.7875 179.3712 92 S 3.9464 8.1971 115.2815 61.8603 63.0034 176.2490 93 H 4.2015 8.6437 120.0328 58.0379 28.2102 177.7997 94 A 2.9847 7.8363 122.5981 54.6582 18.1810 179.0365 95 T 3.7505 7.2322 105.7149 61.9230 69.7328 175.4181 96 K 4.1936 7.4450 120.5182 58.2806 33.3184 176.8583 97 H 4.3389 8.0710 114.0259 56.0101 29.4465 175.3338 98 K 3.7530 7.6799 117.1477 57.4241 28.7447 176.4070 99 I 4.2099 7.9159 119.2170 58.7648 38.3052 175.0359 100 P 4.4235 0.0000 0.0000 62.3058 32.0290 177.6555 101 I 3.3703 8.3719 121.9743 64.5553 36.8744 178.4931 102 K 3.6659 7.9040 119.7668 59.7328 31.9216 178.1834 103 Y 4.0692 8.0630 116.7560 60.5274 37.7449 178.1045 104 L 4.1664 7.8665 120.4683 57.4688 41.6233 178.9496 105 E 3.9623 7.8801 119.0425 59.2309 29.6365 178.6924 106 F 4.4694 7.7680 117.8435 60.8156 38.9241 177.5823 107 I 3.8679 8.2000 118.1483 64.0053 37.7454 178.0992 108 S 4.1879 8.3004 116.4139 61.5579 62.6075 176.3852 109 E 4.0627 8.5862 121.1677 59.3894 29.1876 179.2896 110 A 4.0231 8.0956 120.8257 55.0855 18.3779 179.6728 111 I 3.6792 8.1286 118.6258 64.7581 37.2738 178.7462 112 I 3.8559 7.9717 120.5200 64.5620 36.9541 177.9739 113 H 4.1296 8.5014 119.1570 59.4250 29.6929 177.5446 114 V 3.6129 8.0235 120.0483 65.9592 31.3296 177.9747 115 L 3.7722 8.0302 118.9550 57.7837 41.0450 178.9831 116 H 4.4223 8.0117 117.4963 59.3836 29.9283 177.2689 117 S 4.1977 7.9104 115.9307 61.5709 62.7935 176.4062 118 R 4.1007 7.8385 118.7981 57.3622 31.2378 176.3879 119 H 5.0296 8.1332 115.9888 53.8931 29.9049 172.9395 120 P 4.2692 0.0000 0.0000 65.8660 31.6692 179.3466 121 G 3.6878 8.1582 106.4613 47.4833 0.0000 173.6012 122 D 5.0488 8.0847 117.8261 54.0198 41.4032 176.2421 123 F 5.0194 8.0488 121.4282 56.4039 39.6872 174.8698 124 G 3.8605 8.0583 106.8936 44.0070 0.0000 173.1926 125 A 3.8969 8.4088 121.0341 54.9135 18.2256 179.4531 126 D 4.1900 7.9652 117.0300 56.7857 39.4332 178.7066 127 A 3.9892 7.7679 121.9886 54.4194 18.3467 179.4058 128 Q 3.1766 7.8151 117.2438 58.8491 28.7100 179.3556 129 G 3.4855 8.2440 106.8094 47.6046 0.0000 175.6912 130 A 3.8680 7.9902 123.1598 55.1008 18.3205 179.4473 131 M 4.0060 8.4621 117.2369 58.6462 32.2447 177.8555 132 N 4.3023 8.5282 117.6972 56.7225 39.0296 176.9952 133 K 3.8903 8.1924 119.6258 59.3131 32.1079 179.2025 134 A 3.8250 8.1090 121.3240 55.1817 18.2715 179.7423 135 L 4.1168 8.3008 117.6959 57.6596 41.6874 179.5146 136 E 3.9819 8.5578 119.2133 59.3160 29.4013 179.0498 137 L 4.0109 8.2100 120.5471 57.9657 42.0816 178.5972 138 F 4.1314 8.3683 120.6072 61.6471 39.3038 177.4357 139 R 3.5319 8.2499 117.5393 58.7833 29.8280 178.8620 140 K 3.8109 8.4977 119.8349 59.8080 31.8406 178.6259 141 D 4.3595 8.1732 119.0036 57.2378 40.6734 178.8601 142 I 3.5598 7.6597 120.3476 64.1669 36.9117 178.2927 143 A 3.7037 8.2075 121.8525 54.9872 18.1344 179.5676 144 A 3.9420 7.9441 119.3164 55.1521 18.4006 180.0923 145 K 4.0081 7.8642 116.8160 59.6935 32.0923 179.0714 146 Y 4.0747 8.5522 117.5235 61.0980 37.8018 178.7933 147 K 4.0128 8.5185 120.7287 59.2891 32.0704 178.1156 148 E 3.9228 7.9830 118.7190 59.5831 29.6711 178.5398 149 L 4.3961 7.7776 115.2308 55.1627 41.8758 177.5629 150 G 3.7924 8.2063 107.2287 46.3377 0.0000 173.6404 151 Y 4.6021 8.2924 113.9794 57.1674 39.1770 176.7461 152 Q 4.1403 8.2974 123.0607 58.1498 29.5402 176.0990 153 G 4.0594 8.2863 110.2359 45.7235 0.0000 173.1014 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 V 8.05 4.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.95 0.00 0.00 2 L 8.28 3.96 0.00 0.62 0.61 0.54 -0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.71 4.52 0.00 4.04 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 E 8.85 4.27 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.39 0.00 5 G 8.10 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.21 3.92 0.00 1.96 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 7 W 8.28 4.44 0.00 3.51 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.61 4.09 0.00 2.29 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 9 L 8.01 4.09 0.00 1.97 1.75 0.95 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 10 V 8.03 3.76 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.91 0.00 0.00 11 L 8.51 4.40 0.00 1.86 1.81 0.93 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.29 4.25 0.00 3.34 3.57 0.00 5.95 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.89 3.75 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.81 0.00 0.00 14 W 8.61 3.86 0.00 3.69 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.05 4.02 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.65 3.91 0.00 1.45 1.54 0.00 1.60 0.00 0.00 1.45 0.00 0.00 2.71 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.47 1.43 7.81 17 V 6.92 3.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 0.25 0.00 0.00 18 E 7.31 3.95 0.00 1.87 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.98 0.00 19 A 7.43 4.20 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.97 4.65 0.00 2.64 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.85 3.50 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.84 0.00 0.00 22 A 7.99 4.05 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.38 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 H 8.20 4.15 0.00 3.29 3.24 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.31 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.18 3.87 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.47 0.00 27 D 8.00 4.29 0.00 2.73 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 7.90 3.67 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.67 0.88 0.00 0.00 29 L 7.79 3.43 0.00 1.25 0.73 0.73 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.66 3.57 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.61 0.87 0.00 0.00 31 R 7.92 3.77 0.00 1.89 2.03 0.00 3.06 0.00 0.00 2.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 32 L 7.88 3.94 0.00 1.77 1.50 1.09 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.11 4.59 0.00 3.12 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.19 4.03 0.00 1.75 1.83 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.65 7.81 35 S 8.19 4.28 0.00 3.73 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 H 8.07 4.68 0.00 3.04 2.78 0.00 5.62 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.55 0.00 2.14 2.09 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 38 E 8.24 4.07 0.00 2.29 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.37 0.00 39 T 8.19 4.03 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 40 L 7.88 3.59 0.00 1.22 1.72 -0.01 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.69 3.98 0.00 2.16 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 42 K 8.03 4.47 0.00 1.96 1.73 0.00 1.84 0.00 0.00 1.77 0.00 0.00 3.17 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.74 1.94 7.81 43 F 8.26 4.66 0.00 3.18 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.65 4.40 0.00 2.63 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.89 3.82 0.00 1.48 1.19 0.00 2.99 0.00 0.00 2.88 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.27 0.00 46 F 8.07 5.05 0.00 2.89 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.14 4.13 0.00 1.86 2.20 0.00 1.60 0.00 0.00 1.79 0.00 0.00 3.15 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.67 1.45 7.81 48 H 8.09 4.36 0.00 3.31 3.49 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.70 4.16 0.00 1.61 1.59 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.44 4.54 0.00 1.75 1.80 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.47 7.81 51 T 7.51 4.75 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 52 E 8.66 3.91 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 53 A 7.97 3.98 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 8.16 3.94 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 55 M 8.14 4.19 0.00 2.06 2.26 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.61 0.00 56 K 8.24 4.01 0.00 1.83 1.85 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.57 7.81 57 A 7.66 4.47 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.52 4.35 0.00 3.95 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.85 4.00 0.00 2.14 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 60 D 8.19 4.42 0.00 2.91 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.13 3.46 0.00 1.45 1.64 -0.17 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.95 3.86 0.00 1.88 1.98 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.46 7.81 63 K 8.35 4.00 0.00 2.14 1.94 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.59 7.81 64 H 8.69 4.41 0.00 3.62 3.48 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.40 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 7.73 3.60 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.98 0.00 0.00 67 T 7.92 3.88 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 68 V 7.91 3.58 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.98 0.00 0.00 69 L 8.18 4.24 0.00 1.81 1.93 0.87 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.38 3.97 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 71 A 8.02 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.18 3.75 0.00 1.58 1.69 0.27 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.52 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 A 7.79 4.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.61 3.78 1.90 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.62 0.95 0.00 0.00 76 L 7.89 4.00 0.00 1.19 1.58 -0.15 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.76 4.02 0.00 1.66 1.79 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.46 1.52 7.81 78 K 7.85 3.97 0.00 1.83 1.80 0.00 1.77 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.65 1.77 7.81 79 K 8.32 2.00 0.00 1.21 0.74 0.00 1.46 0.00 0.00 1.40 0.00 0.00 2.64 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.30 0.69 7.81 80 G 8.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 H 7.47 4.57 0.00 3.16 3.24 0.00 5.80 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.31 5.29 0.00 3.28 3.46 0.00 5.66 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.63 3.94 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 84 A 7.92 4.07 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.11 4.11 0.00 2.27 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 86 L 8.18 4.32 0.00 1.74 1.68 0.96 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.90 3.85 0.00 1.83 1.88 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.66 7.81 88 P 0.00 4.30 0.00 2.28 2.31 0.00 3.82 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 89 L 7.51 3.98 0.00 2.00 1.87 0.97 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.54 4.13 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.15 3.78 0.00 2.27 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 92 S 8.20 3.95 0.00 3.86 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 H 8.64 4.20 0.00 3.48 3.57 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.84 2.98 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.23 3.75 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 96 K 7.45 4.19 0.00 1.55 1.72 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.16 1.34 7.81 97 H 8.07 4.34 0.00 3.00 3.14 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.68 3.75 0.00 1.88 1.86 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.38 7.81 99 I 7.92 4.21 2.04 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.92 1.09 0.00 0.00 100 P 0.00 4.42 0.00 1.69 1.77 0.00 2.34 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.80 0.00 101 I 8.37 3.37 1.70 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.60 0.70 0.00 0.00 102 K 7.90 3.67 0.00 1.74 1.70 0.00 1.54 0.00 0.00 1.74 0.00 0.00 3.16 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 0.66 7.81 103 Y 8.06 4.07 0.00 3.11 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.87 4.17 0.00 1.82 1.81 0.63 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 105 E 7.88 3.96 0.00 1.95 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 106 F 7.77 4.47 0.00 3.26 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 8.20 3.87 2.02 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 1.10 0.00 0.00 108 S 8.30 4.19 0.00 4.19 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.59 4.06 0.00 2.28 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.61 0.00 110 A 8.10 4.02 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.13 3.68 2.09 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.73 1.05 0.00 0.00 112 I 7.97 3.86 2.14 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.12 1.18 0.00 0.00 113 H 8.50 4.13 0.00 3.34 3.46 0.00 5.59 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.02 3.61 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.95 0.00 0.00 115 L 8.03 3.77 0.00 1.11 0.42 0.81 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.01 4.42 0.00 3.59 3.59 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.91 4.20 0.00 3.99 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 R 7.84 4.10 0.00 1.47 1.53 0.00 2.73 0.00 0.00 2.70 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.47 0.00 119 H 8.13 5.03 0.00 3.17 3.18 0.00 5.63 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.27 0.00 2.19 2.23 0.00 3.76 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.93 0.00 121 G 8.16 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.08 5.05 0.00 2.76 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 F 8.05 5.02 0.00 2.99 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 G 8.06 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.41 3.90 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 7.97 4.19 0.00 2.87 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.77 3.99 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 7.82 3.18 0.00 1.96 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.83 1.63 0.00 129 G 8.24 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 7.99 3.87 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 M 8.46 4.01 0.00 2.41 2.44 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.89 0.00 132 N 8.53 4.30 0.00 2.85 2.95 0.00 0.00 7.20 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 K 8.19 3.89 0.00 1.86 1.66 0.00 1.58 0.00 0.00 1.50 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.50 7.81 134 A 8.11 3.83 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.30 4.12 0.00 1.74 1.79 0.98 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.56 3.98 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.55 0.00 137 L 8.21 4.01 0.00 1.86 1.97 1.04 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.37 4.13 0.00 3.05 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 8.25 3.53 0.00 2.02 1.85 0.00 3.14 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.97 0.00 140 K 8.50 3.81 0.00 1.74 2.01 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.47 7.81 141 D 8.17 4.36 0.00 2.77 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 I 7.66 3.56 1.32 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 -0.16 0.48 0.00 0.00 143 A 8.21 3.70 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 A 7.94 3.94 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 K 7.86 4.01 0.00 2.04 1.91 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.64 7.81 146 Y 8.55 4.07 0.00 3.05 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.52 4.01 0.00 2.09 2.00 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.47 7.81 148 E 7.98 3.92 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 149 L 7.78 4.40 0.00 1.96 1.94 0.79 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 150 G 8.21 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.29 4.60 0.00 2.65 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 Q 8.30 4.14 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.86 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 153 G 8.29 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00